Geometry & MOs

Info

ID:	139830
PubChem CID:	52603478
Reduced:	SO2H5N5C8 (1)
Stoich.:	AB2C5D5E8 (1)
Weight, g/mol:	334.05359
ΔH_f, kcal/mol:	66.14
Dipole, Da:	6.58
IP(EA), eV:	-9.91(-2.2)
Spin(S_z, S²):	None, None
Charge, e:	0

Chem-info

IUPAC name:

(5-fluoro-2-methoxyphenyl)methyl 3-(tetrazol-1-yl)thiophene-2-carboxylate

Drug info:

PubChemData

Smile

C1=CSC(=C1N2C=NN=N2)C(=O)OCC#N

DOS

IR

Vibrations